| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2005 | 19 | No |
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 4.83 | 6.38 | -6.96 | 1 | 3 | 0 | 45 | 380.039 | 1 | ↓ |
| Hi High (pH 8-9.5) | 5.29 | 4.62 | -37.13 | 0 | 3 | -1 | 48 | 379.031 | 1 | ↓ |
| Hi High (pH 8-9.5) | 5.29 | 4.08 | -40.75 | 0 | 3 | -1 | 48 | 379.031 | 1 | ↓ |
